Calculation of the Huckel Parameter (Beta) from the Free-Electron Model

The Huckel molecular orbital (HMO) is a simple model for conjugated pi systems. Comparison of the free-electron (FE) and the HMO model is used to carry out a reliable estimate of the Huckel parameter beta.

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Veröffentlicht in:	Journal of chemical education 1992-02, Vol.69 (2), p.96
1. Verfasser:	Taubmann, Gerhard
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemistry Free electrons Mathematical models Mathematics Molecular orbitals Parameter estimation
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description	The Huckel molecular orbital (HMO) is a simple model for conjugated pi systems. Comparison of the free-electron (FE) and the HMO model is used to carry out a reliable estimate of the Huckel parameter beta.
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identifier	ISSN: 0021-9584
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language	eng
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source	ACS Publications
subjects	Chemistry Free electrons Mathematical models Mathematics Molecular orbitals Parameter estimation
title	Calculation of the Huckel Parameter (Beta) from the Free-Electron Model
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